[(2R,3S)-3-(4-chlorophenyl)carbonyloxy-2-oxidanyl-5-oxidanylidene-5-phosphonooxy-pentyl] 4-chloranylbenzoate

Systemtic Name: [(2R,3S)-3-(4-chlorophenyl)carbonyloxy-2-oxidanyl-5-oxidanylidene-5-phosphonooxy-pentyl] 4-chloranylbenzoate Openeye Name: [(2R,3S)-3-(4-chlorobenzoyl)oxy-2-hydroxy-5-oxo-5-phosphonooxy-pentyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [(2R,3S)-3-[(4-chlorophenyl)-oxomethoxy]-2-hydroxy-5-oxo-5-phosphonooxypentyl] ester IUPAC Name: [(2R,3S)-3-(4-chlorobenzoyl)oxy-2-hydroxy-5-oxo-5-phosphonooxypentyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [(2R,3S)-3-(4-chlorobenzoyl)oxy-2-hydroxy-5-keto-5-phosphonooxy-pentyl] ester Formula: C19H17Cl2O10P MolecularWeight: 507.212041

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC(C(CC(=O)OP(=O)(O)O)OC(=O)C2=CC=C(C=C2)Cl)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)OC[C@H]([C@H](CC(=O)OP(=O)(O)O)OC(=O)C2=CC=C(C=C2)Cl)O)Cl

InChI

InChI=1S/C19H17Cl2O10P/c20-13-5-1-11(2-6-13)18(24)29-10-15(22)16(9-17(23)31-32(26,27)28)30-19(25)12-3-7-14(21)8-4-12/h1-8,15-16,22H,9-10H2,(H2,26,27,28)/t15-,16+/m1/s1